Skip to main content
. Author manuscript; available in PMC: 2022 Jun 28.
Published in final edited form as: J Chem Inf Model. 2021 Jun 7;61(6):2806–2817. doi: 10.1021/acs.jcim.1c00426

Figure 4:

Figure 4:

AMOEBA+ and QM interaction energies for cation-anion pairs. QM total interaction energy is calculated by CCSD(T)/CBS, while energy components are calculated by SAPT2+. QM energy is represented as solid lines and MM energy is represented as hollow symbols. See Figure 2 caption for the description of the energy components.